[2-[2-(2-methylphenyl)phenyl]phenyl]-diphenylphosphane

C31H25P — CID 142046194

IUPAC[2-[2-(2-methylphenyl)phenyl]phenyl]-diphenylphosphane
SMILESCc1ccccc1-c1ccccc1-c1ccccc1P(c1ccccc1)c1ccccc1
InChIInChI=1S/C31H25P/c1-24-14-8-9-19-27(24)28-20-10-11-21-29(28)30-22-12-13-23-31(30)32(25-15-4-2-5-16-25)26-17-6-3-7-18-26/h2-23H,1H3
InChIKeyFLBYLWQOJBWVJT-UHFFFAOYSA-N
MW428.52 g/mol
LogP7.09
Rot. Bonds5

About [2-[2-(2-methylphenyl)phenyl]phenyl]-diphenylphosphane

[2-[2-(2-methylphenyl)phenyl]phenyl]-diphenylphosphane (PubChem CID 142046194) has the molecular formula C31H25P and a molecular weight of 428.52 g/mol. Its IUPAC name is [2-[2-(2-methylphenyl)phenyl]phenyl]-diphenylphosphane.

Molecular Properties

Compound Name[2-[2-(2-methylphenyl)phenyl]phenyl]-diphenylphosphane
PubChem CID142046194
Molecular FormulaC31H25P
Molecular Weight428.52 g/mol
Exact Mass428.17
IUPAC Name[2-[2-(2-methylphenyl)phenyl]phenyl]-diphenylphosphane
SMILESCc1ccccc1-c1ccccc1-c1ccccc1P(c1ccccc1)c1ccccc1
InChIInChI=1S/C31H25P/c1-24-14-8-9-19-27(24)28-20-10-11-21-29(28)30-22-12-13-23-31(30)32(25-15-4-2-5-16-25)26-17-6-3-7-18-26/h2-23H,1H3
InChIKeyFLBYLWQOJBWVJT-UHFFFAOYSA-N
XLogP7.09
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500428.52
LogP ≤ 57.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

bis([2-(2-diphenylphosphanylphenyl)phenyl]-diphenylphosphane);hydrate
CID 87203660
[3-methyl-2-(2-methylphenyl)phenyl]-bis(4-methylphenyl)phosphane
CID 151240435
(2-diphenylphosphanylphenyl)-diphenylphosphane;titanium
CID 174974517
[2-(2,3,4,5,6-pentafluorophenyl)phenyl]-diphenylphosphane
CID 158378188
diphenyl-[2-[2-[(E)-1-phenylprop-1-enyl]phenyl]phenyl]phosphane
CID 164669457
ethene;1-methyl-2-(2-methylphenyl)benzene
CID 145078997
CID 10959964
CID 10959964
[2-(4-fluorophenyl)phenyl]-diphenylphosphane
CID 101050042
carbonic acid;1-methyl-2-(2-methylphenyl)benzene
CID 67741238
trichlororhodium;triphenylphosphane;1,2-xylene
CID 174728734
diphenyl-[2-(2,3,4-triphenylnaphthalen-1-yl)phenyl]phosphane
CID 166447914
bis(2-methylbenzoyl)phosphanyl-(2-methylphenyl)methanone;triphenylphosphane
CID 90341440

Frequently Asked Questions

What is the IUPAC name of [2-[2-(2-methylphenyl)phenyl]phenyl]-diphenylphosphane?
The IUPAC name of [2-[2-(2-methylphenyl)phenyl]phenyl]-diphenylphosphane (CID 142046194) is [2-[2-(2-methylphenyl)phenyl]phenyl]-diphenylphosphane.
What is the SMILES notation for [2-[2-(2-methylphenyl)phenyl]phenyl]-diphenylphosphane?
The canonical SMILES for [2-[2-(2-methylphenyl)phenyl]phenyl]-diphenylphosphane is Cc1ccccc1-c1ccccc1-c1ccccc1P(c1ccccc1)c1ccccc1.
What is the InChIKey of [2-[2-(2-methylphenyl)phenyl]phenyl]-diphenylphosphane?
The InChIKey is FLBYLWQOJBWVJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H25P/c1-24-14-8-9-19-27(24)28-20-10-11-21-29(28)30-22-12-13-23-31(30)32(25-15-4-2-5-16-25)26-17-6-3-7-18-26/h2-23H,1H3.
What are the key properties of [2-[2-(2-methylphenyl)phenyl]phenyl]-diphenylphosphane?
[2-[2-(2-methylphenyl)phenyl]phenyl]-diphenylphosphane has a molecular weight of 428.52 g/mol, XLogP of 7.09, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[2-(2-methylphenyl)phenyl]phenyl]-diphenylphosphane is sourced from PubChem (CID 142046194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).